IFLAB-ZINC05148053 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0210 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -0.5010 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 -1.0250 1.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -1.2060 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -1.0420 -1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -0.4750 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -0.4630 -2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 -1.0330 -3.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 -1.3590 -2.3960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -1.1610 -4.6240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -0.7180 -5.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -0.8200 -6.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -0.1740 -4.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -0.0180 -3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 0.4790 -2.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 0.2720 -5.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -1.7500 -5.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -1.5540 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -0.2930 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3150 0.7900 0.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3290 -0.3750 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0980 0.7940 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4730 0.7100 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0950 -0.5300 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3380 -1.6920 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9630 -1.6230 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4440 -0.6050 0.1340 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.3680 2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 0.0780 -6.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 -0.2710 -4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 1.3410 -5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -2.8260 -5.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -1.3080 -6.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 -1.5530 -4.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2530 -2.1340 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 -2.1440 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 1.7600 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0680 1.6110 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8290 -2.6550 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 -2.5280 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -1.2640 2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -0.2470 3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 0.5020 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 M END